Garcia-Sosa, A. T.; Maran, U. Using combined docking, chemical fingerprints, and Bayesian classifiers for the androgen receptor binding activity of the CoMPARA data. Toxicological Sciences 2020.
Compound
| ID: | 103725-47-9 | |
|---|---|---|
| Name: | Betiatide | |
| Description: | ||
| Labels: | eval | |
| CAS: | 103725-47-9 | |
| InChi Code: | InChI=1S/C15H17N3O6S/c19-11(16-6-12(20)18-8-14(22)23)7-17-13(21)9-25-15(24)10-4-2-1-3-5-10/h1-5H,6-9H2,(H,16,19)(H,17,21)(H,18,20)(H,22,23) |
Properties
bindingClass: Androgen Receptor Binding Class
| Value | Source or prediction |
|---|---|
| 0 |
experimental value |
| 0.098509263 |
Proc.13: Procedure 13, Multivariate Logistic Regression (predicted Binding Class) |